Ethanone, 1-(4-methyl-3-pyridinyl)-


Chemical Name: Ethanone, 1-(4-methyl-3-pyridinyl)-
CAS Number: 51227-30-6
Product Number: AG00DHXA(AGN-PC-0ND87E)
Synonyms:
MDL No:
Molecular Formula: C8H9NO
Molecular Weight: 135.1632

Identification/Properties


Computed Properties
Molecular Weight:
135.166g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
135.068g/mol
Monoisotopic Mass:
135.068g/mol
Topological Polar Surface Area:
30A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
133
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(4-Methyl-3-pyridinyl)-Ethanone, also known as $name$, is a versatile compound frequently utilized in chemical synthesis processes. Its unique structural composition makes it a valuable building block for the creation of various pharmaceuticals, agrochemicals, and fine chemicals. In particular, $name$ serves as a key intermediate in the synthesis of heterocyclic compounds, which are crucial in the development of new drugs and biologically active molecules. Furthermore, its reactivity and functional groups enable efficient derivatization and modification, allowing for the production of a diverse range of chemical products. By leveraging the capabilities of 1-(4-Methyl-3-pyridinyl)-Ethanone, chemists can streamline synthetic pathways and enhance the efficiency of their research and development endeavors.